Name: Name:3-(2,2-difluoroethoxy)-4-nitro-1H-pyrazole
Brand: Angene
SKU: AG01AOTG
Rating: 90 (10 reviews)

3-(2,2-difluoroethoxy)-4-nitro-1H-pyrazole

CAS No.:

1787881-30-4

Catalog Number:

AG01AOTG

Molecular Formula:

C5H5F2N3O3

Molecular Weight:

193.1083

Catalog Number:

AG01AOTG

Chemical Name:

3-(2,2-difluoroethoxy)-4-nitro-1H-pyrazole

CAS Number:

1787881-30-4

Molecular Formula:

C5H5F2N3O3

Molecular Weight:

193.1083

MDL Number:

MFCD28962816

IUPAC Name:

5-(2,2-difluoroethoxy)-4-nitro-1H-pyrazole

InChI:

InChI=1S/C5H5F2N3O3/c6-4(7)2-13-5-3(10(11)12)1-8-9-5/h1,4H,2H2,(H,8,9)

InChI Key:

IVZGNFMNYGCHAS-UHFFFAOYSA-N

SMILES:

FC(COc1n[nH]cc1[N+](=O)[O-])F

Complexity:

186

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.11g/mol

Monoisotopic Mass:

193.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2